[1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine

C9H17F3N2O — CID 103151497

IUPAC[1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
SMILESNNC(CCOCC(F)(F)F)C1CCC1
InChIInChI=1S/C9H17F3N2O/c10-9(11,12)6-15-5-4-8(14-13)7-2-1-3-7/h7-8,14H,1-6,13H2
InChIKeyYBPSTEBVEGYFHO-UHFFFAOYSA-N
MW226.24 g/mol
LogP1.59
Rot. Bonds6

About [1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine

[1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine (PubChem CID 103151497) has the molecular formula C9H17F3N2O and a molecular weight of 226.24 g/mol. Its IUPAC name is [1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine.

Molecular Properties

Compound Name[1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
PubChem CID103151497
Molecular FormulaC9H17F3N2O
Molecular Weight226.24 g/mol
Exact Mass226.13
IUPAC Name[1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
SMILESNNC(CCOCC(F)(F)F)C1CCC1
InChIInChI=1S/C9H17F3N2O/c10-9(11,12)6-15-5-4-8(14-13)7-2-1-3-7/h7-8,14H,1-6,13H2
InChIKeyYBPSTEBVEGYFHO-UHFFFAOYSA-N
XLogP1.59
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-Cyclobutyl-3-(2,2-difluoroethoxy)propan-1-amine
CID 103149040
[1-Cycloheptyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151444
[7-Methyl-1-(2,2,2-trifluoroethoxy)octan-3-yl]hydrazine
CID 103151446
[5-Methyl-1-(2,2,2-trifluoroethoxy)heptan-3-yl]hydrazine
CID 103151447
[1-Cyclopropyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
CID 103151457
1-(2,2,2-Trifluoroethoxy)heptan-3-ylhydrazine
CID 103151459
[5-Methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine
CID 103151460
[1-Cyclobutyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
CID 103151501
[1-Cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
CID 103151504
[1-(5-Oxaspiro[3.5]nonan-8-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151509
[5-Ethyl-1-(2,2,2-trifluoroethoxy)nonan-3-yl]hydrazine
CID 103151536
[1-Cyclohexyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
CID 103151539

Frequently Asked Questions

What is the IUPAC name of [1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The IUPAC name of [1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine (CID 103151497) is [1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine.
What is the SMILES notation for [1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The canonical SMILES for [1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine is NNC(CCOCC(F)(F)F)C1CCC1.
What is the InChIKey of [1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The InChIKey is YBPSTEBVEGYFHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F3N2O/c10-9(11,12)6-15-5-4-8(14-13)7-2-1-3-7/h7-8,14H,1-6,13H2.
What are the key properties of [1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
[1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine has a molecular weight of 226.24 g/mol, XLogP of 1.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine is sourced from PubChem (CID 103151497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).